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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP006414

3-[(2R,3R)-2-(furan-3-yl)-4-[2-[(4R,5R)-4-(2-methoxy-2-oxoethyl)-3,3,5-trimethyl-6-oxocyclohexen-1-yl]acetyl]-3-methyl-6-oxo-2H-pyran-3-yl]propanoic acid

Formula: C27H32O9  |  Mol. Weight: 500.50 g/mol

IUPAC: 3-[(2R,3R)-2-(furan-3-yl)-4-[2-[(4R,5R)-4-(2-methoxy-2-oxoethyl)-3,3,5-trimethyl-6-oxocyclohexen-1-yl]acetyl]-3-methyl-6-oxo-2H-pyran-3-yl]propanoic acid

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Overview

Molecular Formula C27H32O9
Molecular Weight 500.50 g/mol
Canonical SMILES CC1C(C(C=C(C1=O)CC(=O)C2=CC(=O)OC(C2(C)CCC(=O)O)C3=COC=C3)(C)C)CC(=O)OC

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy